N-[3-methyl-4-[2-[(4-methyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]phenyl]-3-phenyl-propanamide

Systemtic Name: N-[3-methyl-4-[2-[(4-methyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]phenyl]-3-phenyl-propanamide Openeye Name: N-[3-methyl-4-[[2-[[4-methyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]phenyl]-3-phenyl-propanamide CAS Name: N-[3-methyl-4-[[2-[(4-methyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]amino]phenyl]-3-phenylpropanamide IUPAC Name: N-[3-methyl-4-[[2-[(4-methyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]phenyl]-3-phenylpropanamide Traditional Name: N-[3-methyl-4-[[2-[[4-methyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]acetyl]amino]phenyl]-3-phenyl-propionamide Formula: C25H25N5O2S2 MolecularWeight: 491.6283

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)CCC2=CC=CC=C2)NC(=O)CSC3=NN=C(N3C)C4=CC=CS4

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)CCC2=CC=CC=C2)NC(=O)CSC3=NN=C(N3C)C4=CC=CS4

InChI

InChI=1S/C25H25N5O2S2/c1-17-15-19(26-22(31)13-10-18-7-4-3-5-8-18)11-12-20(17)27-23(32)16-34-25-29-28-24(30(25)2)21-9-6-14-33-21/h3-9,11-12,14-15H,10,13,16H2,1-2H3,(H,26,31)(H,27,32)